3-Hydroxykynurenine
TL;DR: 3-Hydroxykynurenine (CAS 484-78-6) is a chemical compound with molecular formula C10H12N2O4 and molecular weight 224.07971 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid
Also Known As: 3-Hydroxykynurenine, 3-Hydroxy-dl-kynurenine, Hydroxykynurenine, dl-3-Hydroxykynurenine, Hydroxykinurenine
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12N2O4 |
| Molecular Weight | 224.07971 g/mol |
| XLogP | -2.5 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.07971 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| Melting Point | 217 °C |
| SMILES | C1=CC(=C(C(=C1)O)N)C(=O)CC(C(=O)O)N |
| InChIKey | VCKPUUFAIGNJHC-UHFFFAOYSA-N |
Product Description
Applications: 3-Hydroxykynurenine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
3-Hydroxykynurenine (CAS 484-78-6) is a pharmaceutical intermediate with the molecular formula C10H12N2O4 and a molecular weight of 224.08 g/mol. Synonyms include 3-Hydroxykynurenine and 3-Hydroxy-dl-kynurenine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3-Hydroxykynurenine
Property Insights of 3-Hydroxykynurenine
The XLogP value of -2.5 indicates that 3-Hydroxykynurenine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxykynurenine. Following Lipinski's Rule of Five, 3-Hydroxykynurenine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Hydroxykynurenine?
The CAS number of 3-Hydroxykynurenine is 484-78-6.
What is the molecular formula of 3-Hydroxykynurenine?
The molecular formula of 3-Hydroxykynurenine is C10H12N2O4.
What is the molecular weight of 3-Hydroxykynurenine?
The molecular weight of 3-Hydroxykynurenine is 224.07971 g/mol.
What are the applications of 3-Hydroxykynurenine?
3-Hydroxykynurenine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 3-Hydroxykynurenine?
You can request a quote for 3-Hydroxykynurenine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Hydroxykynurenine?
Yes, CoreyChem provides custom synthesis services for 3-Hydroxykynurenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.